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DIMETHYL-(1-METHYL-3-METHYLTHIO-1H-1,2,4-TRIAZOL-5-YL)-IMINODITHIOCARBONATE
SpectraBase Compound ID A1Sz3Ws3cZf
InChI InChI=1S/C7H12N4S3/c1-11-5(8-6(10-11)12-2)9-7(13-3)14-4/h1-4H3
InChIKey KOGYLEYTWPVYRM-UHFFFAOYSA-N
Mol Weight 248.38 g/mol
Molecular Formula C7H12N4S3
Exact Mass 248.02241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Gvbg8hYKrX
Name DIMETHYL-(1-METHYL-3-METHYLTHIO-1H-1,2,4-TRIAZOL-5-YL)-IMINODITHIOCARBONATE
Compound Number 4A/1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12N4S3
InChI InChI=1S/C7H12N4S3/c1-11-5(8-6(10-11)12-2)9-7(13-3)14-4/h1-4H3
InChIKey KOGYLEYTWPVYRM-UHFFFAOYSA-N
Literature Reference Author J.REITER,L.PONGO,I.PALLAGI
Literature Reference Citation J.HETCYCL.CHEM.,27,1689(1990)
Literature Reference DOI 10.1002/jhet.5570270633
Molecular Weight 248.379 g/mol
Solvent CDCl3
Source File Reference UWCP3276